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Journal of Chemical Information and Modeling
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August 7, 2023
Comparative Performance of High-Throughput Methods for Protein p<i>K</i><sub>a</sub> Predictions
Wanlei Wei, Hervé Hogues, Traian Sulea
Frontiers in Molecular Biosciences
|
February 23, 2024
Editorial: Progress and challenges in computational structure-based design and development of biologic drugs
Traian Sulea, Sandeep Kumar, Daisuke Kuroda
Journal of Chemical Information and Modeling
|
August 19, 2015
Evaluation of the Wilma-SIE Virtual Screening Method in Community Structure-Activity Resource 2013 and 2014 Blind Challenges
Hervé Hogues, Traian Sulea, Enrico O Purisima
Biological Chemistry
|
August 18, 2006
Structural aspects of recently discovered viral deubiquitinating activities
Traian Sulea, Holger A Lindner, Robert Ménard
Journal of Computational Chemistry
|
September 22, 2006
Coupled atomic charge selectivity for optimal ligand-charge distributions at protein binding sites
Sathesh Bhat, Traian Sulea, Enrico O Purisima
Journal of Chemical Information and Modeling
|
July 1, 2011
Solvated interaction energy (SIE) for scoring protein-ligand binding affinities. 2. Benchmark in the CSAR-2010 scoring exercise
Traian Sulea, Qizhi Cui, Enrico O Purisima
Journal of Computer-Aided Molecular Design
|
December 27, 2011
Exhaustive search and solvated interaction energy (SIE) for virtual screening and affinity prediction
Traian Sulea, Hervé Hogues, Enrico O Purisima
Scientific Reports
|
September 13, 2023
Enhanced antibody-antigen structure prediction from molecular docking using AlphaFold2
Francis Gaudreault, Christopher R Corbeil, Traian Sulea
Bioinformatics (Oxford, England)
|
March 26, 2025
AI-augmented physics-based docking for antibody-antigen complex prediction
Francis Gaudreault, Traian Sulea, Christopher R Corbeil
Journal of Computer-Aided Molecular Design
|
January 30, 2014
Exhaustive docking and solvated interaction energy scoring: lessons learned from the SAMPL4 challenge
Hervé Hogues, Traian Sulea, Enrico O Purisima
Page
of 10
Search research articles
Search
Showing results (11-20 of 93) with videos related to
Sort By:
Page
of 10
Journal of Chemical Information and Modeling
|
August 7, 2023
Comparative Performance of High-Throughput Methods for Protein p<i>K</i><sub>a</sub> Predictions
Wanlei Wei, Hervé Hogues, Traian Sulea
Frontiers in Molecular Biosciences
|
February 23, 2024
Editorial: Progress and challenges in computational structure-based design and development of biologic drugs
Traian Sulea, Sandeep Kumar, Daisuke Kuroda
Journal of Chemical Information and Modeling
|
August 19, 2015
Evaluation of the Wilma-SIE Virtual Screening Method in Community Structure-Activity Resource 2013 and 2014 Blind Challenges
Hervé Hogues, Traian Sulea, Enrico O Purisima
Biological Chemistry
|
August 18, 2006
Structural aspects of recently discovered viral deubiquitinating activities
Traian Sulea, Holger A Lindner, Robert Ménard
Journal of Computational Chemistry
|
September 22, 2006
Coupled atomic charge selectivity for optimal ligand-charge distributions at protein binding sites
Sathesh Bhat, Traian Sulea, Enrico O Purisima
Journal of Chemical Information and Modeling
|
July 1, 2011
Solvated interaction energy (SIE) for scoring protein-ligand binding affinities. 2. Benchmark in the CSAR-2010 scoring exercise
Traian Sulea, Qizhi Cui, Enrico O Purisima
Journal of Computer-Aided Molecular Design
|
December 27, 2011
Exhaustive search and solvated interaction energy (SIE) for virtual screening and affinity prediction
Traian Sulea, Hervé Hogues, Enrico O Purisima
Scientific Reports
|
September 13, 2023
Enhanced antibody-antigen structure prediction from molecular docking using AlphaFold2
Francis Gaudreault, Christopher R Corbeil, Traian Sulea
Bioinformatics (Oxford, England)
|
March 26, 2025
AI-augmented physics-based docking for antibody-antigen complex prediction
Francis Gaudreault, Traian Sulea, Christopher R Corbeil
Journal of Computer-Aided Molecular Design
|
January 30, 2014
Exhaustive docking and solvated interaction energy scoring: lessons learned from the SAMPL4 challenge
Hervé Hogues, Traian Sulea, Enrico O Purisima
Page
of 10